Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-
TL;DR: Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- (CAS 28652-48-4) is a chemical compound with molecular formula C11H11Cl6O3P and molecular weight 431.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(2,2,2-trichloroethoxy)phosphoryl]-2-methylbenzene
Also Known As: Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-, Tolylphosphonic acid bis(2,2,2-trichloroethyl) ester, Bis(2,2,2-trichloroethyl) (2-methylphenyl)phosphonate, 1-[bis(2,2,2-trichloroethoxy)phosphoryl]-2-methylbenzene, RefChem:370601
| Molecular Formula | C11H11Cl6O3P |
|---|---|
| Molecular Weight | 431.86 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.8577 |
| Heavy Atoms | 21 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 28652-48-4 |
|---|---|
| SMILES | CC1=CC=CC=C1P(=O)(OCC(Cl)(Cl)Cl)OCC(Cl)(Cl)Cl |
| InChIKey | VLHHFOJEUPVXDS-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- (CAS 28652-48-4), with molecular formula C11H11Cl6O3P and molecular weight 431.86 g/mol. IUPAC: 1-[bis(2,2,2-trichloroethoxy)phosphoryl]-2-methylbenzene.
Chemical Property Profile of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-
Property Insights of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-
The XLogP value of 5.1 indicates that Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-?
The CAS number of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- is 28652-48-4.
What is the molecular formula of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-?
The molecular formula of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- is C11H11Cl6O3P.
What is the molecular weight of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-?
The molecular weight of Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- is 431.86 g/mol.
Where can I buy Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-?
You can request a quote for Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, tolyl-, bis(2,2,2-trichloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.